對氧磷
TL;DR: 對氧磷 (CAS 311-45-5) is a chemical compound with molecular formula C10H14NO6P and molecular weight 275.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
對氧磷
diethyl (4-nitrophenyl) phosphate
Also Known As: PARAOXON, Phosphacol, Miotisal, Diethyl paraoxon, Ethyl paraoxon
| Molecular Formula | C10H14NO6P |
|---|---|
| Molecular Weight | 275.06 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 90.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 275.05588 |
| Heavy Atoms | 18 |
| Complexity | 300.0 |
| Melting Point | 300 °C |
| Boiling Point | 336 to 170.0 °C at 760 mmHg |
| Density | 1.274 at 20.0 °C |
| Solubility | Sparingly soluble (NTP, 1992) |
| Vapor Pressure | 0.0000011 [mmHg] |
| Refractive Index | 1.50959 @ 20 °C; MAX ABSORPTION: 274 NM (E= 8.9X10+3) |
Chemical Identifiers
| CAS Number | 311-45-5 |
|---|---|
| SMILES | CCOP(=O)(OCC)OC1=CC=C(C=C1)[N+](=O)[O-] |
| InChIKey | WYMSBXTXOHUIGT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
對氧磷 (CAS 311-45-5), with molecular formula C10H14NO6P and molecular weight 275.06 g/mol. IUPAC: diethyl (4-nitrophenyl) phosphate.
Chemical Property Profile of 對氧磷
Property Insights of 對氧磷
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 對氧磷. The TPSA of 90.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 對氧磷. Following Lipinski's Rule of Five, 對氧磷 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 對氧磷?
The CAS number of 對氧磷 is 311-45-5.
What is the molecular formula of 對氧磷?
The molecular formula of 對氧磷 is C10H14NO6P.
What is the molecular weight of 對氧磷?
The molecular weight of 對氧磷 is 275.06 g/mol.
Where can I buy 對氧磷?
You can request a quote for 對氧磷 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 對氧磷?
Yes, KEHONG BIO provides custom synthesis services for 對氧磷 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.